1-(4-tert-butylphenyl)carbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-(4-tert-butylphenyl)carbonyl-7-(1,4-diazepan-1-ylcarbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(4-tert-butylbenzoyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(4-tert-butylphenyl)-oxomethyl]-7-[1,4-diazepan-1-yl(oxo)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(4-tert-butylbenzoyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(4-tert-butylbenzoyl)-7-(1,4-diazepane-1-carbonyl)-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C32H36N4O3 MolecularWeight: 524.65324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N4CCCNCC4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)N4CCCNCC4)C5=CC=CC=C5

InChI

InChI=1S/C32H36N4O3/c1-32(2,3)25-13-10-23(11-14-25)31(39)36-27-15-12-24(30(38)35-18-7-16-33-17-19-35)20-26(27)34-29(37)21-28(36)22-8-5-4-6-9-22/h4-6,8-15,20,28,33H,7,16-19,21H2,1-3H3,(H,34,37)